Geometry & MOs

Info

ID:	360745
PubChem CID:	127301390
Reduced:	SN3O3C11H19 (1)
Stoich.:	AB3C3D11E19 (1)
Weight, g/mol:	272.119464
ΔH_f, kcal/mol:	-74.78
Dipole, Da:	4.43
IP(EA), eV:	-8.79(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(2-ethylpiperidin-1-yl)sulfonylmethyl]-3-methyl-1,2-oxazole

Drug info:

PubChemData

Smile

CCN1CCN(CC1)S(=O)(=O)CC2=CC(=NO2)C

DOS

IR

Vibrations